이름: 2-ethoxy-4-aminobenzoic acid
SMILES:
CCOc1cc(N)ccc1C(=O)OMolecular Processing
Molecular formula
C9H11NO3
Molecular weight
181.19
Exact mass
181.0739
XLogP
1.37
TPSA
72.55
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
13
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.222
Molar refractivity
48.98
Supplementary Information
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